3-(2,4-Dichlorophenyl)propanenitrile

Base Information

Chemical Name:3-(2,4-Dichlorophenyl)propanenitrile
CAS No.:16994-09-5
Molecular Formula:C₉H₇Cl₂N
Molecular Weight:200.067
Hs Code.:
DSSTox Substance ID:DTXSID501300997
Mol file:16994-09-5.mol

Synonyms:3-(2,4-DICHLOROPHENYL)PROPANENITRILE;16994-09-5;Benzenepropanenitrile, 2,4-dichloro-;2,4-dichloroBenzenepropanenitrile;DTXSID501300997;2,4-Dichloro-Benzenepropanenitrile;AKOS010643871;FT-0727561;A18296;EN300-1983526

Suppliers and Price of 3-(2,4-Dichlorophenyl)propanenitrile

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Labseeker
3-(2,4-dichlorophenyl)propanenitrile 95
10g
$ 2163.00

American Custom Chemicals Corporation
3-(2,4-DICHLOROPHENYL)PROPANENITRILE 95.00%
5MG
$ 497.82

Total 7 raw suppliers

Chemical Property of 3-(2,4-Dichlorophenyl)propanenitrile

Chemical Property:

Boiling Point:327.0±27.0 °C(Predicted)
PSA：23.79000
Density:1.282±0.06 g/cm3(Predicted)
LogP:3.44958
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:198.9955546
Heavy Atom Count:12
Complexity:184

Purity/Quality:

97% ^*data from raw suppliers

3-(2,4-dichlorophenyl)propanenitrile 95 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1Cl)Cl)CCC#N

Technology Process of 3-(2,4-Dichlorophenyl)propanenitrile

There total 3 articles about 3-(2,4-Dichlorophenyl)propanenitrile which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 16994-08-4
α-Cyan-2,4-dichlor-hydrozimtsaeure

: 16994-09-5
2,4-Dichlor-hydrozimtsaeure-nitril

Guidance literature:: In N,N-dimethyl acetamide; at 150 ℃;
DOI:10.1021/jo01272a068

Reference yield:

: 16994-07-3
methyl 2-cyano-(2,4-dichlorophenyl)propionate

: 16994-09-5
2,4-Dichlor-hydrozimtsaeure-nitril

Guidance literature:: Multi-step reaction with 2 steps

1: aq. NaOH

2: N,N-dimethyl-acetamide / 150 °C

With sodium hydroxide; In N,N-dimethyl acetamide;
DOI:10.1021/jo01272a068

Reference yield:

: 94-99-5
2,4-Dichlorobenzyl chloride

: 16994-09-5
2,4-Dichlor-hydrozimtsaeure-nitril

Guidance literature:: Multi-step reaction with 3 steps

1: (i) NaOMe, (ii) /BRN= 387220/

2: aq. NaOH

3: N,N-dimethyl-acetamide / 150 °C

With sodium hydroxide; In N,N-dimethyl acetamide;
DOI:10.1021/jo01272a068